SCHEMBL30869388

SCHEMBL30869388

Cc1cc2c(cc1-c1ccc3[nH]ncc3c1)Oc1cc(-c3ccc4[nH]ncc4c3)cnc1N2CCOCCN1CC2COCC(C2)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 4/20 0.37
KCNH2 Q12809 1/20 0.36
ROCK2 O75116 4/20 0.33
ROCK1 Q13464 4/20 0.33
MAP3K11 Q16584 1/20 0.33
TNIK Q9UKE5 1/20 0.33
ESR1 P03372 2/20 0.33
LRRK2 Q5S007 1/20 0.33
TRPA1 O75762 1/20 0.33
MAPK14 Q16539 1/20 0.32
PIK3CD O00329 1/20 0.31
EGFR P00533 2/20 0.30
GPR84 Q9NQS5 1/20 0.30
MAP4K4 O95819 1/20 0.30
ERBB2 P04626 1/20 0.30
MAPK9 P45984 1/20 0.30
CSNK1D P48730 1/20 0.30
PRKD2 Q9BZL6 1/20 0.30
SLK Q9H2G2 1/20 0.30
CDC7 O00311 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30869738 0.94 CHRNA7 (0.38) CHRNA7KCNH2ROCK2ROCK1MAP3K11
SCHEMBL30869505 0.94 CHRNA7 (0.38) CHRNA7KCNH2ROCK2ROCK1MAP3K11
SCHEMBL30869708 0.93 CHRNA7 (0.38) CHRNA7KCNH2ROCK2ROCK1MAP3K11
SCHEMBL30869432 0.91 CHRNA7 (0.39) CHRNA7KCNH2ROCK2ROCK1MAP3K11
SCHEMBL30869762 0.90 CHRNA7 (0.39) CHRNA7KCNH2ROCK2ROCK1MAP3K11
SCHEMBL30869469 0.88 EGFR (0.42) CHRNA7ROCK2ROCK1MAP3K11TNIK
SCHEMBL30869563 0.87 CHRNA7 (0.35) CHRNA7KCNH2ROCK2ROCK1MAP3K11
SCHEMBL30869751 0.86 GRIA1 (0.35) CHRNA7KCNH2ROCK2ROCK1MAP3K11
SCHEMBL30869688 0.85 CHRNA7 (0.38) CHRNA7KCNH2ROCK2ROCK1MAP3K11
SCHEMBL30869750 0.84 CHRNA7 (0.41) CHRNA7KCNH2ROCK2ROCK1MAP3K11

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4583868-A2 DYNAMIN ACTIVATORS Walden Biosciences, Inc. (US) 2025-07-16 EP disclosed
WO-2024054661-A2 DYNAMIN ACTIVATORS WALDEN BIOSCIENCES (US) 2024-03-14 WO disclosed